Vitas-M small molecule compound
methyl 2-{[(2-phenylethyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK437158
SMILES COC(=O)c1c(NC(=S)NCCc2ccccc2)sc2c1CCCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H22N2O2S2 MW 374.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O2S2/c1-23-18(22)16-14-9-5-6-10-15(14)25-17(16)21-19(24)20-12-11-13-7-3-2-4-8-13/h2-4,7-8H,5-6,9-12H2,1H3,(H2,20,21,24)InChIKey
YFBLCHVKPYHDIR-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCC2)NC(=S)NCCC3=CC=CC=C3
InChI=1SC19H22N2O2S2c12318(22)16149561015(14)2517(16)2119(24)201211137324813h2478H56912H21H3(H2202124)
methyl2(((2phenylethyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(2phenylethylcarbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD03944752
ZINC000017076684
ZINC17076684
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